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Home > Encyclopedia > β-Alanine, N-[N-[N-[5-(hexahydro-2-oxo-1H-thieno[3,4-d]imidazol-4-yl)-1-oxopentyl]-L-tryptophyl]-L-leucyl]-, [3aS-(3aα,4β,6aα)]-

β-Alanine, N-[N-[N-[5-(hexahydro-2-oxo-1H-thieno[3,4-d]imidazol-4-yl)-1-oxopentyl]-L-tryptophyl]-L-leucyl]-, [3aS-(3aα,4β,6aα)]-

β-Alanine, N-[N-[N-[5-(hexahydro-2-oxo-1H-thieno[3,4-d]imidazol-4-yl)-1-oxopentyl]-L-tryptophyl]-L-leucyl]-, [3aS-(3aα,4β,6aα)]- structure

β-Alanine, N-[N-[N-[5-(hexahydro-2-oxo-1H-thieno[3,4-d]imidazol-4-yl)-1-oxopentyl]-L-tryptophyl]-L-leucyl]-, [3aS-(3aα,4β,6aα)]- 

structure
  • CAS No:

    127745-41-9

  • Formula:

    C30H42N6O6S

  • Chemical Name:

    β-Alanine, N-[N-[N-[5-(hexahydro-2-oxo-1H-thieno[3,4-d]imidazol-4-yl)-1-oxopentyl]-L-tryptophyl]-L-leucyl]-, [3aS-(3aα,4β,6aα)]-

  • Synonyms:

    β-Alanine,N-[N-[N-[5-(hexahydro-2-oxo-1H-thieno[3,4-d]imidazol-4-yl)-1-oxopentyl]-L-tryptophyl]-L-leucyl]-,[3aS-(3aα,4β,6aα)]-;1H-Thieno[3,4-d]imidazole,β-alanine deriv.

β-Alanine, N-[N-[N-[5-(hexahydro-2-oxo-1H-thieno[3,4-d]imidazol-4-yl)-1-oxopentyl]-L-tryptophyl]-L-leucyl]-, [3aS-(3aα,4β,6aα)]- Basic Attributes

614.75600

614.76

Characteristics

220.78000

4.53250

1.273g/cm3

1072ºC

601ºC

1.594

0mmHg at 25°C

Drug Information

biotinyl-Trp-Leu-beta-Ala

Computed Properties

Molecular Weight:614.8
XLogP3:2.1
Hydrogen Bond Donor Count:7
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:16
Exact Mass:614.28865425
Monoisotopic Mass:614.28865425
Topological Polar Surface Area:207
Heavy Atom Count:43
Complexity:1010
Undefined Atom Stereocenter Count:5
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

Guide of β-Alanine, N-[N-[N-[5-(hexahydro-2-oxo-1H-thieno[3,4-d]imidazol-4-yl)-1-oxopentyl]-L-tryptophyl]-L-leucyl]-, [3aS-(3aα,4β,6aα)]-

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